2-(2,6-dibromo-4-chloroanilino)-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide
Formula:C15H10N3OBr2Cl3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-(2,6-dibromo-4-chloroanilino)-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide is not a drug-like molecule.
| MolName | 2-(2,6-dibromo-4-chloroanilino)-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide |
| MolecularFormula | C15H10N3OBr2Cl3 |
| Smiles | O=C(CNc(c(Br)cc(Cl)c1)c1Br)N/N=C\c(ccc(Cl)c1)c1Cl |
| InChI | InChI=1S/C15H10Br2Cl3N3O/c16-11-3-10(19)4-12(17)15(11)21-7-14(24)23-22-6-8-1-2-9(18)5-13(8)20/h1-6,21H,7H2,(H,23,24) |
| InChIK | OLTILGDKWFKEFI-UHFFFAOYSA-N |
| TotalMolweight | 514.431 |
| Molweight | 514.431 |
| MonoisotopicMass | 510.825615 |
| CLogP | 5.7619 |
| CLogS | -7.419 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 295.73 |
| Relative PSA | 0.16052 |
| PolarSurfaceArea | 53.49 |
| Druglikeness | 3.2557 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; polyhalo aromatic ring |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 3 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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1 - 2-(2,6-dibromo-4-chloroanilino)-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide | 2 - 2-(2,6-dibromo-4-chloroanilino)-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide
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